Vitas-M small molecule compound
(E)-{2-(3,4-dimethoxyphenyl)-1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(3-methoxyphenyl)methanolate
Catalog ID
STK564011
SMILES COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)OC)OC)CCCn1cc[nH+]c1)/[O-]
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C26H27N3O6 MW 477.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O6/c1-33-19-7-4-6-18(14-19)24(30)22-23(17-8-9-20(34-2)21(15-17)35-3)29(26(32)25(22)31)12-5-11-28-13-10-27-16-28/h4,6-10,13-16,23,30H,5,11-12H2,1-3H3/b24-22+InChIKey
KPDLQQIYSJFGCI-ZNTNEXAZSA-NSynonyms
609316-21-4(4E)5(34DIMETHOXYPHENYL)4(HYDROXY(3METHOXYPHENYL)METHYLIDENE)1(3IMIDAZOL1YLPROPYL)PYRROLIDINE23DIONE
(E)(2(34dimethoxyphenyl)1(3(1Himidazol3ium1yl)propyl)45dioxopyrrolidin3ylidene)(3methoxyphenyl)methanolate
5(34DIMETHOXYPHENYL)3HYDROXY1(3IMIDAZOLYLPROPYL)4((3METHOXYPHENYL)CARBONYL)3PYRROLIN2ONE
609316214
COC1=C(C=C(C=C1)C2C(=C(C3=CC(=CC=C3)OC)O)C(=O)C(=O)N2CCCN4C=CN=C4)OC
COc1cccc(c1)C(=C1C(=O)C(=O)N(C1c1ccc(c(c1)OC)OC)CCCn1cc(nH+)c1)(O)
InChI=1SC26H27N3O6c1331974618(1419)24(30)2223(178920(342)21(1517)353)29(26(32)25(22)31)12511281310271628h461013162330H51112H213H3b2422+
MFCD18244438
ZINC000102525142
ZINC000102525150
Check stock
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Check stock on Vitas-MAvailable files
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